Charge: 2
Inchi:1S/C20H12/c1-2-7-17-15(4-1)12-16-9-8-13-5-3-6-14-10-11-18(17)20(16)19(13)14/h1-12H/q+2
Electronic States
Energy
(eV)
-768.18063
Description
D0
Multiplicity
2
Is Minimum
yes
Symmetry Group
Cs
Symmetry Elements
E
sigmah(xy)
Rotational Constants
(cm-1)
0.02857 b
(cm-1)
0.00852 c
(cm-1)
0.00656
Dipole Moments
mu_x(Debye)
-0.12448 mu_y
(Debye)
-0.13148 mu_z
(Debye)
0.00000
Vibration Analisys
Harmonic:
link
Anharmonic:
None
Vibration Analisis Harmonic
Diff mu X
(Debye)
0.00000
Diff mu Y
(Debye)
0.00000
Diff mu Z
(Debye)
1.16700
Eigenvectors
#
X
Y
Z
1
0.00000
0.00000
-0.06314
2
0.00000
0.00000
0.06782
3
0.00000
0.00000
0.00471
4
0.00000
0.00000
-0.02032
5
0.00000
0.00000
0.02465
6
0.00000
0.00000
-0.02203
7
0.00000
0.00000
0.00396
8
0.00000
0.00000
0.01236
9
0.00000
0.00000
-0.00908
10
0.00000
0.00000
0.01484
11
0.00000
0.00000
0.01417
12
0.00000
0.00000
-0.01684
13
0.00000
0.00000
0.01101
14
0.00000
0.00000
-0.01819
15
0.00000
0.00000
0.06147
16
0.00000
0.00000
-0.02587
17
0.00000
0.00000
-0.03748
18
0.00000
0.00000
-0.05684
19
0.00000
0.00000
-0.02754
20
0.00000
0.00000
-0.05978
21
0.00000
0.00000
-0.05401
22
0.00000
0.00000
-0.03030
23
0.00000
0.00000
-0.03197
24
0.00000
0.00000
-0.00945
25
0.00000
0.00000
0.18370
26
0.00000
0.00000
-0.20141
27
0.00000
0.00000
0.19051
28
0.00000
0.00000
0.19796
29
0.00000
0.00000
0.44702
30
0.00000
0.00000
0.39152
31
0.00000
0.00000
0.33733
32
0.00000
0.00000
0.27145